Slater type basis sets, density fit and frozen core approximation
ADFinput: Select Model → Main Options.
Select the basis set from the 'Basis Set' Menu.
Select the frozen core from the 'Core Type' Menu.
ADFUsersGuide: STO [1,2],
density fit [1],
frozen core approximation [1].
Ghost atoms, Alternative elements, expert atomic options
ADFinput: Ghost atoms: by right clicking on an atom (or selection),
you can choose to change the atom(s) to ghost atom(s) from the pop-up menu.
ADFinput: Alternative elements, expert atomic options: Select Details → Atom inspector.
Move the mouse over the check buttons to see a help balloon which will give you details on what it is, and on how to change it.
ADFUsersGuide: Ghost atoms, alternative elements [1].
Nuclear Model
ADFinput: Select Details → Relativity.
Select 'PointCharge' or 'Gaussian' (finite size nucleus) for 'Nuclear Model'.
ADFUsersGuide: nuclear model [1].




